1-Ethanol, 2-[(3,5-dinitrophenyl)thio]-

SpectraBase Compound ID	9c7m0wVeCah
InChI	InChI=1S/C8H8N2O5S/c11-1-2-16-8-4-6(9(12)13)3-7(5-8)10(14)15/h3-5,11H,1-2H2
InChIKey	UFNOXBTYOMAHDT-UHFFFAOYSA-N Google Search
Mol Weight	244.22 g/mol
Molecular Formula	C8H8N2O5S
Exact Mass	244.015393 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	5CMSWPq2WjS
Name	1-Ethanol, 2-[(3,5-dinitrophenyl)thio]-
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	244.015392535 u
Formula	C8H8N2O5S
InChI	InChI=1S/C8H8N2O5S/c11-1-2-16-8-4-6(9(12)13)3-7(5-8)10(14)15/h3-5,11H,1-2H2
InChIKey	UFNOXBTYOMAHDT-UHFFFAOYSA-N
Molecular Weight	244.221 g/mol
SMILES	C(O)CSC1=CC(N(=O)=O)=CC(N(=O)=O)=C1
Spectrum/Structure Validation Score (Vapor Phase IR)	0.93645